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Agustí Lledós

Name: dblp XML data dump
Creator: Schloss Dagstuhl - Leibniz Center for Informatics
Published: 1993
License: https://creativecommons.org/publicdomain/zero/1.0/
Keywords: dblp, XML, computer science, scholarly publications, metadata

◀ ▶ joint publications with Jean-Didier Maréchal

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Publications

2019
[j5]
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  dblp key:
  - journals/jcc/PedregalFSSULMM19
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  persistent URL:
  - https://dblp.org/rec/journals/jcc/PedregalFSSULMM19
Jaime Rodríguez-Guerra Pedregal, Ignacio Funes-Ardoiz, Giuseppe Sciortino, José-Emilio Sánchez-Aparicio, Gregori Ujaque, Agustí Lledós, Jean-Didier Maréchal, Feliu Maseras:
GARLEEK: Adding an extra flavor to ONIOM. J. Comput. Chem. 40(2): 381-386 (2019)
2018
[j4]
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  dblp key:
  - journals/jcc/SciortinoPLGM18
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  persistent URL:
  - https://dblp.org/rec/journals/jcc/SciortinoPLGM18
Giuseppe Sciortino, Jaime Rodríguez-Guerra Pedregal, Agustí Lledós, Eugenio Garribba, Jean-Didier Maréchal:
Prediction of the interaction of metallic moieties with proteins: An update for protein-ligand docking techniques. J. Comput. Chem. 39(1): 42-51 (2018)
2014
[j3]
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  dblp key:
  - journals/jcc/Ortega-CarrascoLM14
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  persistent URL:
  - https://dblp.org/rec/journals/jcc/Ortega-CarrascoLM14
Elisabeth Ortega-Carrasco, Agustí Lledós, Jean-Didier Maréchal:
Assessing protein-ligand docking for the binding of organometallic compounds to proteins. J. Comput. Chem. 35(3): 192-198 (2014)
2006
[j2]
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  dblp key:
  - journals/jcc/MarechalMLMP06
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  persistent URL:
  - https://dblp.org/rec/journals/jcc/MarechalMLMP06
Jean-Didier Maréchal, Feliu Maseras, Agustí Lledós, Liliane Mouawad, David Pérahia:
A DFT study on the relative affinity for oxygen of the and subunits of hemoglobin. J. Comput. Chem. 27(12): 1446-1453 (2006)
2000
[j1]
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  dblp key:
  - journals/jcc/MarechalBMLMP00
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  persistent URL:
  - https://dblp.org/rec/journals/jcc/MarechalBMLMP00
Jean-Didier Maréchal, Guada Barea, Feliu Maseras, Agustí Lledós, Liliane Mouawad, David Pérahia:
Theoretical modeling of the heme group with a hybrid QM/MM method. J. Comput. Chem. 21(4): 282-294 (2000)

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